1-(3-bromophenyl)-3-(phenethylcarbamothioylamino)thiourea

Systemtic Name: 1-(3-bromophenyl)-3-(phenethylcarbamothioylamino)thiourea Openeye Name: 1-(3-bromophenyl)-3-(phenethylcarbamothioylamino)thiourea CAS Name: 1-[[(3-bromoanilino)-sulfanylidenemethyl]amino]-3-phenethylthiourea IUPAC Name: 1-(3-bromophenyl)-3-(phenethylcarbamothioylamino)thiourea Traditional Name: 1-(3-bromophenyl)-3-(phenethylthiocarbamoylamino)thiourea Formula: C16H17BrN4S2 MolecularWeight: 409.36698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NNC(=S)NC2=CC(=CC=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NNC(=S)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C16H17BrN4S2/c17-13-7-4-8-14(11-13)19-16(23)21-20-15(22)18-10-9-12-5-2-1-3-6-12/h1-8,11H,9-10H2,(H2,18,20,22)(H2,19,21,23)